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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:40:49 UTC
Update Date2025-03-21 17:58:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00017146
Frequency247.0
Structure
Chemical FormulaC10H11Cl2N
Molecular Mass215.0269
SMILESClc1ccc(C2CCCN2)cc1Cl
InChI KeyLTITXVXGJJQFJC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass phenylpyrrolidines
Direct Parent phenylpyrrolidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl chlorides
  • azacyclic compounds
  • dialkylamines
  • dichlorobenzenes
  • hydrocarbon derivatives
  • organochlorides
  • organopnictogen compounds
  • pyrroles
    • Substituents
  • aryl chloride
  • chlorobenzene
  • secondary aliphatic amine
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • azacycle
  • 2-phenylpyrrolidine
  • organochloride
  • secondary amine
  • organohalogen compound
  • aryl halide
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 1,2-dichlorobenzene
  • benzenoid
  • organic nitrogen compound
  • halobenzene
  • amine